Chapter 467 Monte Carlo Simulations of Organic Photovoltaics
(2014)
Book Chapter
Groves, C., & Greenham, N. (2014). Chapter 467 Monte Carlo Simulations of Organic Photovoltaics. In D. Beljonne, & J. Cornil (Eds.), Computational Photovoltaics. Springer Berlin Heidelberg. https://doi.org/10.1007/128_2013_467
Modeling OPV Performance - Morphology, Transport and Recombination (2014)
Book Chapter
Groves, C. (2014). Modeling OPV Performance - Morphology, Transport and Recombination. In B. Rand, & H. Richter (Eds.), Organic Solar Cells - Fundamentals, Devices and Upsacling. Pan Stanford. https://doi.org/10.4032/9789814463669
Energetically Demanding transport in a Supramolecular Assembly (2014)
Journal Article
Cheng, C., McGonigal, P. R., Liu, W., Li, H., Vermeulen, N. A., Ke, C., …Stoddart, J. F. (2014). Energetically Demanding transport in a Supramolecular Assembly. Journal of the American Chemical Society, 136(42), 14702-14705. https://doi.org/10.1021/ja508615f
Electron Delocalization in a Rigid Cofacial Naphthalene-1,8:4,5-bis(dicarboximide) Dimer (2014)
Journal Article
Wu, Y., Frasconi, M., Gardner, D. M., McGonigal, P. R., Schneebeli, S. T., Wasielewski, M. R., & Stoddart, J. F. (2014). Electron Delocalization in a Rigid Cofacial Naphthalene-1,8:4,5-bis(dicarboximide) Dimer. Angewandte Chemie International Edition, 53(36), 9476-9481. https://doi.org/10.1002/anie.201403816
An ExBox [2] catenane (2014)
Journal Article
Juricek, M., Barnes, J. C., Strutt, N. L., Vermeulen, N. A., Ghooray, K. C., Dale, E. J., …Stoddart, J. F. (2014). An ExBox [2] catenane. Chemical Science, 5(7), 2724-2731. https://doi.org/10.1039/c4sc00488d
Solid-State Characterization and Photoinduced Intramolecular Electron Transfer in a Nanoconfined Octacationic Homo[2]Catenane (2014)
Journal Article
Barnes, J. C., Frasconi, M., Young, R. M., Khdary, N. H., Liu, W., Dyar, S. M., …Stoddart, J. F. (2014). Solid-State Characterization and Photoinduced Intramolecular Electron Transfer in a Nanoconfined Octacationic Homo[2]Catenane. Journal of the American Chemical Society, 136(30), 10569-10572. https://doi.org/10.1021/ja505093d
Gold(I) Carbenes by Retro-Buchner Reaction: Generation and Fate (2014)
Journal Article
Wang, Y., McGonigal, P. R., Herle, B., Besora, M., & Echavarren, A. M. (2014). Gold(I) Carbenes by Retro-Buchner Reaction: Generation and Fate. Journal of the American Chemical Society, 136(2), 801-809. https://doi.org/10.1021/ja411626v
ZIC1 and SOST immunohistochemistry staining of osteocytes and osteoblasts in femoral head tissue (2014)
Journal Article
Younis, S., Walker, J., Wu, J., Datta, H., & Tuck, S. (2014). ZIC1 and SOST immunohistochemistry staining of osteocytes and osteoblasts in femoral head tissue. Osteoporosis International, 25,
Construction and Characterization of Kilobasepair Densely Labeled Peptide-DNA (2014)
Journal Article
Kovacic, S., Samii, L., Lamour, G., Li, H., Linke, H., Bromley, E., …Forde, N. (2014). Construction and Characterization of Kilobasepair Densely Labeled Peptide-DNA. Biomacromolecules, 15(11), https://doi.org/10.1021/bm501109p
Do structural alterations mediated by enzymatic activities influence the mechanical properties of capsular biomembranes? (2014)
Conference Proceeding
Wu, J., Andrews, R., Quinlan, R., & Tholozan, F. (2014). Do structural alterations mediated by enzymatic activities influence the mechanical properties of capsular biomembranes?. In Proceedings of 10th International Congress on Membranes and Membrane Processes
Evidence for explosive silicic volcanism on the Moon from the extended distribution of thorium near the Compton-Belkovich Volcanic Complex (2014)
Journal Article
Wilson, J., Eke, V., Massey, R., Elphic, R., Jolliff, B., Lawrence, D., …Teodoro, L. (2015). Evidence for explosive silicic volcanism on the Moon from the extended distribution of thorium near the Compton-Belkovich Volcanic Complex. Journal of Geophysical Research: Planets, 120(1), 92-108. https://doi.org/10.1002/2014je004719We reconstruct the abundance of thorium near the Compton-Belkovich Volcanic Complex on the Moon, using data from the Lunar Prospector Gamma Ray Spectrometer. We enhance the resolution via a pixon image reconstruction technique and find that the thori... Read More about Evidence for explosive silicic volcanism on the Moon from the extended distribution of thorium near the Compton-Belkovich Volcanic Complex.
Nonisothermal viscous sintering of volcanic ash (2014)
Journal Article
Wadsworth, F. B., Vasseur, J., von Aulock, F. W., Hess, K., Scheu, B., Lavallée, Y., & Dingwell, D. B. (2014). Nonisothermal viscous sintering of volcanic ash. Journal of Geophysical Research. Solid Earth, 119(12), 8792-8804. https://doi.org/10.1002/2014jb011453Volcanic ash is often deposited in a hot state. Volcanic ash containing glass, deposited above the glass transition interval, has the potential to sinter viscously both to itself (particle‐particle) and to exposed surfaces. Here we constrain the kine... Read More about Nonisothermal viscous sintering of volcanic ash.
Composition as a Means to Control Morphology and Properties of Epoxy Based Dual-Phase Structural Electrolytes (2014)
Journal Article
Shirshova, N., Bismarck, A., Greenhalgh, E. S., Johansson, P., Kalinka, G., Marczewski, M. J., …Wienrich, M. (2014). Composition as a Means to Control Morphology and Properties of Epoxy Based Dual-Phase Structural Electrolytes. Journal of Physical Chemistry C, 118(49), 28377-28387. https://doi.org/10.1021/jp507952bStructural electrolytes were prepared using a fully formulated commercially available high performance epoxy resin (MTM57) and an ionic liquid based electrolyte: lithium bis(trifluoromethylsulfonyl)imide (LiTFSI) dissolved in 1-ethyl-3-methylimidazol... Read More about Composition as a Means to Control Morphology and Properties of Epoxy Based Dual-Phase Structural Electrolytes.
Thermodynamics of the self-assembly of non-ionic chromonic molecules using atomistic simulations. The case of TP6EO2M in aqueous solution (2014)
Journal Article
Akinshina, A., Walker, M., Wilson, M., Tiddy, G., Masters, A., & Carbone, P. (2015). Thermodynamics of the self-assembly of non-ionic chromonic molecules using atomistic simulations. The case of TP6EO2M in aqueous solution. Soft Matter, 11(4), 680-691. https://doi.org/10.1039/c4sm02275kAtomistic molecular dynamic simulations have been performed for the non-ionic chromonic liquid crystal 2,3,6,7,10,11-hexa-(1,4,7-trioxa-octyl)-triphenylene (TP6EO2M) in aqueous solution. TP6EO2M molecules consist of a central poly-aromatic core (a tr... Read More about Thermodynamics of the self-assembly of non-ionic chromonic molecules using atomistic simulations. The case of TP6EO2M in aqueous solution.
Determination of dynamic surface tension and viscosity of non-Newtonian fluids from drop oscillations (2014)
Journal Article
Yang, L., Kazmierski, B. K., Hoath, S. D., Jung, S., Hsiao, W., Wang, Y., …Bain, C. D. (2014). Determination of dynamic surface tension and viscosity of non-Newtonian fluids from drop oscillations. Physics of Fluids, 26(11), Article 113103. https://doi.org/10.1063/1.4901823The oscillations of free-falling drops with size range from pl to μl have been used to measure the transient shear viscosity and the dynamic surface tension of shear-thinning fluids on the timescale of 10−5–10−2 s. The method is first validated with... Read More about Determination of dynamic surface tension and viscosity of non-Newtonian fluids from drop oscillations.
Insights into the Crystallisation Process from Anhydrous, Hydrated and Solvated Crystal Forms of Diatrizoic Acid (2014)
Journal Article
Fucke, K., McIntyre, G. J., Lemee-Cailleay, M., Wilkinson, C., Edwards, A. J., Howard, J. A., & Steed, J. W. (2015). Insights into the Crystallisation Process from Anhydrous, Hydrated and Solvated Crystal Forms of Diatrizoic Acid. Chemistry - A European Journal, 21(3), 1036-1047. https://doi.org/10.1002/chem.201404693Diatrizoic acid (DTA), a clinically used X-ray contrast agent, crystallises in two hydrated, three anhydrous and nine solvated solid forms, all of which have been characterised by X-ray crystallography. Single-crystal neutron structures of DTA dihydr... Read More about Insights into the Crystallisation Process from Anhydrous, Hydrated and Solvated Crystal Forms of Diatrizoic Acid.
Highly Interlocked Anion-Bridged Supramolecular Networks from Interrupted Imidazole-Urea Gels (2014)
Journal Article
James, S., Perrin, A., Jones, C., Yufit, D., & Steed, J. (2014). Highly Interlocked Anion-Bridged Supramolecular Networks from Interrupted Imidazole-Urea Gels. Chemical Communications, 50(85), 12851-12854. https://doi.org/10.1039/c4cc05789aAn imidazole urea displays switchable hydrogelation behaviour that is turned off by metal ion coordination to give anion-bound coordination complex arrays.
An optimization model for a monopolistic firm serving an environmentally conscious market: Use of Chemical Reaction Optimization Algorithm (2014)
Journal Article
Choudhary, A., Suman, R., Dixit, V., Tiwari, M., Fernandes, K., & Chang, P. (2015). An optimization model for a monopolistic firm serving an environmentally conscious market: Use of Chemical Reaction Optimization Algorithm. International Journal of Production Economics, 164, 409-420. https://doi.org/10.1016/j.ijpe.2014.10.011This work considers a monopolist firm which faces the following twin challenges of serving an environmentally sensitive market. The first challenge is the demand׳s elasticity to emissions and price. To entice its emission conscious customers and gene... Read More about An optimization model for a monopolistic firm serving an environmentally conscious market: Use of Chemical Reaction Optimization Algorithm.
Delayed self-regulation and time-dependent chemical drive leads to novel states in epigenetic landscapes (2014)
Journal Article
Mitra, M., Taylor, P., Hutchison, C., McLeish, T., & Chakrabarti, B. (2014). Delayed self-regulation and time-dependent chemical drive leads to novel states in epigenetic landscapes. Journal of the Royal Society. Interface, 11(100), https://doi.org/10.1098/rsif.2014.0706The epigenetic pathway of a cell as it differentiates from a stem cell state to a mature lineage-committed one has been historically understood in terms of Waddington's landscape, consisting of hills and valleys. The smooth top and valley-strewn bott... Read More about Delayed self-regulation and time-dependent chemical drive leads to novel states in epigenetic landscapes.
Ion structure controls ionic liquid near-surface and interfacial nanostructure (2014)
Journal Article
Elbourne, A., Voïtchovsky, K., Warr, G., & Atkin, R. (2015). Ion structure controls ionic liquid near-surface and interfacial nanostructure. Chemical Science, 6(1), 527-536. https://doi.org/10.1039/c4sc02727bA unique, but unifying, feature of ionic liquids (ILs) is that they are nanostructured on the length scale of the ions; in many ILs well-defined polar and apolar domains exist and may percolate through the liquid. Near a surface the isotropic symmetr... Read More about Ion structure controls ionic liquid near-surface and interfacial nanostructure.
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